SCHEMBL31332734

SCHEMBL31332734

COC(C)(CNC(=O)NC1COC2(CCCC2)C1)c1cccc(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CCR1 P32246 1/20 0.34
CCR3 P51677 1/20 0.34
GRM5 P41594 6/20 0.33
EPHX2 P34913 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
EPHX1 P07099 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
TP53 P04637 1/20 0.32
TRPV3 Q8NET8 1/20 0.32
MAPK8 P45983 1/20 0.32
HTT P42858 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31332801 0.82 EPHX2 (0.49) EPHX2MEN1KMT2AEPHX1NPC1
SCHEMBL31332653 0.82 EPHX2 (0.49) EPHX2MEN1KMT2AEPHX1NPC1
SCHEMBL31332620 0.80 EPHX2 (0.40) CCR1CCR3GRM5EPHX2MEN1
SCHEMBL31332607 0.78 EPHX2 (0.46) EPHX2MEN1KMT2AEPHX1NPC1
SCHEMBL31332770 0.77 NPC1 (0.44) CYP3A4CYP2C9CYP2C19NPC1LMNA
SCHEMBL31332809 0.76 SLC6A4 (0.46) PTGDR2CYP3A4CYP2C9CYP2C19GRM5
SCHEMBL31332634 0.74 EPHX1 (0.54) CYP3A4CYP2C9CYP2C19CCR1CCR3
SCHEMBL31332705 0.74 EPHX1 (0.54) CYP3A4CYP2C9CYP2C19CCR1CCR3
SCHEMBL31332799 0.73 POLB (0.53) EPHX2MEN1KMT2AEPHX1NPC1
SCHEMBL31332632 0.72 LMNA (0.50) MEN1KMT2ANPC1LMNATSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709708-A1 NOVEL CARBOXAMIDE DERIVATIVES ANGELINI PHARMA S.P.A. (IT) 2026-03-18 EP disclosed
WO-2024233603-A1 NOVEL CARBOXAMIDE DERIVATIVES ICAGEN, LLC (US) 2024-11-14 WO disclosed